%chk=000287602.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287602

0 1
O 3.713716 -2.395875 -0.640062
O 2.902245 2.457417 1.191738
O -5.454860 -0.447676 0.524535
C 2.347071 -0.434593 -0.793012
C 0.946360 -0.580514 -0.148858
C 2.882826 1.005144 -0.738028
C 0.002237 0.531952 -0.560235
C 0.344222 -1.945757 -0.532611
C 1.888545 1.982122 -1.385390
C 3.325545 -1.384483 -0.104379
C 0.451954 1.669035 -1.116836
C 3.239762 1.411832 0.691731
C -0.984530 -2.165366 0.191132
C -1.428605 0.300773 -0.275617
C 3.751827 -1.010510 1.301514
C 4.159088 0.451480 1.429287
C -1.911858 -0.988494 0.064263
C -2.342783 1.366224 -0.327697
C -3.268533 -1.189487 0.321872
C -3.703622 1.188970 -0.071923
C -4.152500 -0.097418 0.248217
C -6.459525 0.594404 0.482253
H 2.267768 -0.727427 -1.873616
H 1.047432 -0.518456 0.966187
H 3.840802 1.047499 -1.322575
H 1.047406 -2.767824 -0.298423
H 0.185591 -1.990479 -1.629596
H 2.053177 2.003759 -2.483770
H 2.105731 3.013868 -1.019906
H -0.232594 2.466866 -1.411524
H -0.807289 -2.360537 1.271448
H -1.470456 -3.085068 -0.197646
H 2.915487 -1.242803 1.996669
H 4.586523 -1.669318 1.625814
H 5.193622 0.600759 1.052130
H 4.203234 0.739605 2.502654
H -1.985123 2.370126 -0.571957
H -3.661595 -2.170125 0.579560
H -4.379315 2.034449 -0.121426
H -6.525407 1.018004 -0.523895
H -6.245778 1.358809 1.234711
H -7.371099 0.037312 0.735165


%chk=000287602-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287602

0 1
O 3.853211 -2.366802 -0.853904
O 2.840922 2.418907 1.327818
O -5.559790 -0.464090 0.531814
C 2.367139 -0.422340 -0.812575
C 0.971475 -0.569960 -0.130290
C 2.904898 1.043499 -0.714005
C 0.005515 0.545521 -0.546958
C 0.355156 -1.955070 -0.458825
C 1.922844 2.033305 -1.366734
C 3.390019 -1.388560 -0.209229
C 0.469079 1.686585 -1.138619
C 3.259020 1.386306 0.744237
C -0.962336 -2.153381 0.309086
C -1.443395 0.309187 -0.268533
C 3.827916 -1.086671 1.226494
C 4.220767 0.407185 1.426086
C -1.920728 -0.982850 0.128324
C -2.398871 1.358817 -0.357606
C -3.293113 -1.185569 0.376734
C -3.769929 1.162442 -0.107407
C -4.223817 -0.129899 0.258598
C -6.560212 0.599001 0.413562
H 2.253024 -0.679040 -1.883251
H 1.097001 -0.513462 0.974533
H 3.872273 1.073467 -1.262729
H 1.067766 -2.762477 -0.205558
H 0.172538 -2.014884 -1.549886
H 2.125944 2.095995 -2.456172
H 2.115695 3.044444 -0.954929
H -0.242867 2.449268 -1.479066
H -0.735962 -2.269062 1.390350
H -1.453935 -3.093173 -0.004492
H 2.982617 -1.326871 1.902367
H 4.663399 -1.756142 1.491051
H 5.224019 0.572781 0.981105
H 4.288905 0.661433 2.497102
H -2.066735 2.371435 -0.608063
H -3.664187 -2.174240 0.668560
H -4.459438 2.008008 -0.187239
H -6.593751 1.008701 -0.614870
H -6.365323 1.418545 1.132614
H -7.520054 0.117912 0.652400


